3-(2-Propen-1-ylamino)-1-propanol
Basic information
- CAS
44768-46-9- Standard SMILES
C=CCNCCCO- InChIKey
REEDHRZKDCEJEW-UHFFFAOYSA-N- Molecular formula
- C6H13NO
- Average molar mass
- 115.17 g/mol
- Monoisotopic mass
- 115.09971404
Names & identifiers
- Preferred name
- 3-(2-Propen-1-ylamino)-1-propanol
- IUPAC
- 3-(prop-2-enylamino)propan-1-ol
Names & synonyms
44768-46-93-(2-Propen-1-ylamino)-1-propanolRefChem:2739243-(Allylamino)propan-1-olallylhydroxypropylamine3-[(prop-2-en-1-yl)amino]propan-1-olSCHEMBL1083159SCHEMBL1083160SCHEMBL11142797DTXSID901300682AKOS009033727
Database identifiers
- CAS
44768-46-9- PubChem CID
- 15469760
- DTXSID
DTXSID901300682- Nikkaji
- J1.275.405A
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 54.5
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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